4-Morpholinopiperidine → [3-(4-hydroxy-3,5-dimethylphenyl)-1-(4-morpholin-4-ylpiperidin-1-yl)-1-oxopropan-2-yl] 4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carboxylate
반응식
[NH:36]1[CH2:37][CH2:38][CH:39]([N:42]2[CH2:43][CH2:44][O:45][CH2:46][CH2:47]2)[CH2:40][CH2:41]1.[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:32][cH:33][cH:34][cH:35]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([CH2:19][c:20]2[cH:21][c:22]([CH3:28])[c:23]([OH:27])[c:24]([CH3:26])[cH:25]2)[C:29](=[O:30])[OH:31])[CH2:13][CH2:14]1>>[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:32][cH:33][cH:34][cH:35]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([CH2:19][c:20]2[cH:21][c:22]([CH3:28])[c:23]([OH:27])[c:24]([CH3:26])[cH:25]2)[C:29](=[O:30])[N:36]2[CH2:37][CH2:38][CH:39]([N:42]3[CH2:43][CH2:44][O:45][CH2:46][CH2:47]3)[CH2:40][CH2:41]2)[CH2:13][CH2:14]1참가 물질
3
반응물 2
생성물 1
출처 및 근거
- ORD 기록
- ord-6bdb57d3ad3d40e889feb1f811652f25
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)